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44 Commits

Author SHA1 Message Date
giannozz 0a930cec39 *** empty log message *** 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1299 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-15 16:29:09 +00:00
ballabio 41df5bb309 added info about the ARCH variable in configure [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1295 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-15 15:33:16 +00:00
giannozz a47030ad32 Final (?) documentation changes 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1291 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-15 14:22:51 +00:00
sbraccia f50f901233 path optimizations: added the possibility to write the prefix.save file (logical varible write_save) relative to each 
image (needed for post-processing). C.S.


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1290 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-15 12:35:54 +00:00
sbraccia c1a8678e12 *** empty log message *** 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1283 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-14 15:36:52 +00:00
giannozz 209835b458 *** empty log message *** 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1276 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-13 17:48:59 +00:00
giannozz 8e7efba9cf *** empty log message *** 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1266 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-13 12:56:58 +00:00
giannozz cbd3d66e3c CP: pressure in GPa, not in kbar 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1256 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-09 09:34:39 +00:00
ballabio 571e653409 reworked manual configuration section [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1254 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-08 14:57:04 +00:00
sbraccia a77634bef9 *** empty log message *** 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1249 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-07 15:10:59 +00:00
giannozz 8046a9ea1f Minor corrections 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1245 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-06 16:26:43 +00:00
ballabio 39378ac025 small modifications [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1243 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-06 15:46:21 +00:00
ballabio c1790428d9 make (very)clean must not remove bin/ [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1224 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-03 10:57:12 +00:00
ballabio 3ab1ab263c completed merge of manual and README.install [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1223 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-03 10:44:31 +00:00
ballabio 43fbba4acd Syncronized manual.tex with README.install 
manual.tex needs more tweaking, I'm doing it tomorrow [Gerardo]


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1216 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-02 17:05:57 +00:00
giannozz 8e192519a9 Update 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1214 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-02 15:13:39 +00:00
dalcorso 9378651e7c Bug fix: The dipole correction was not working with a 
non-tetragonal cell. (Contributed by N. Bonini).


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1211 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-02 14:01:57 +00:00
sbraccia 62dfe2f99c Doc updated. C.S. 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1204 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-02 08:11:14 +00:00
giannozz 81e5586878 Doc update 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1200 c92efa57-630b-4861-b058-cf58834340f0
 2004-09-01 17:55:48 +00:00
ballabio ef74b52de1 more little cosmetic changes [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1195 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-31 16:25:02 +00:00
ballabio 7c5f93d45c cosmetic changes (eliminate "overfull hbox"'s) [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1194 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-31 14:50:05 +00:00
sbraccia c2729a5276 Other updates. C.S. 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1189 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-27 14:33:44 +00:00
giannozz e9fb1facae Documentation update 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1188 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-27 14:23:09 +00:00
sbraccia ff4fbcdada Update. C.S. 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1180 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-26 17:00:26 +00:00
giannozz ace8b915bb Misc small changes 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1174 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-26 09:33:01 +00:00
giannozz d06f20ea1b Makefiles and examples updated 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1169 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-25 09:54:04 +00:00
giannozz 55cf54e6c5 *** empty log message *** 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1167 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-24 16:14:59 +00:00
ballabio 16be6268b8 *** empty log message *** 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1150 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-20 16:50:34 +00:00
ballabio 53c8dd914c Syncronized manual with CREDITS file [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1149 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-20 16:33:15 +00:00
ballabio 4a56dddb1b reordered subsections of "Installation" section 
enlarged title, didn't fit any more in a single page anyway
[Gerardo]


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1141 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-20 09:56:56 +00:00
ballabio 4e6da74495 pasted CP manual into PWscf manual as section "Using FPMD and CP" 
changed title to "User's Guide to ESPRESSO"
replaced "PWscf" with "ESPRESSO" where appropriate
other minor changes
[Gerardo]


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1140 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-20 09:37:32 +00:00
sbraccia 28545662b8 Updated the BFGS-Troubleshooting section. 
C.S.


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1138 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-20 08:34:44 +00:00
sbraccia 15df30915f *** empty log message *** 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1134 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-19 16:24:39 +00:00
ballabio 0ce3cfd276 translated FPMD/CP manual to LaTeX [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1131 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-19 15:10:29 +00:00
ballabio df26b9a391 more small changes [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1130 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-19 14:18:59 +00:00
giannozz 82ff0eb696 Manual update 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1128 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-19 13:30:53 +00:00
giannozz 9b2ddc028c More compilation problems 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1124 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-18 16:22:16 +00:00
sbraccia fce371bd20 *** empty log message *** 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1121 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-18 16:05:51 +00:00
ballabio e609978f49 small updates [Gerardo] 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1118 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-18 15:44:24 +00:00
giannozz 4c879bb7e8 Documentation update 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1113 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-17 15:46:49 +00:00
giannozz c2ebbb73fb Documentation for Raman updated 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1109 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-13 14:51:48 +00:00
giannozz b9aca5db58 Manual update and cleanup; added RANLIB=echo to old Make.* 
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1107 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-12 09:08:38 +00:00
ballabio 25e6630269 added postscript figures 
found how to make both latex and pdflatex happy (just write the file
name with no extension and provide both postscript and PNG)
various reformatting and cleanup of the manual (no more "overfull
hbox"'s)
[Gerardo]


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1106 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-10 18:04:11 +00:00
giannozz f17501572d Support for mac-osx added (contributed by Pascal Thibaudeau) 
Extensive documentation update and reshuffling : pwdocs and cpdocs merged
into Doc


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@1104 c92efa57-630b-4861-b058-cf58834340f0
 2004-08-09 16:35:51 +00:00